N-[4-(4-isoquinolin-8-ylpiperazin-1-yl)butyl]anthracene-2-carboxamide

Systemtic Name: N-[4-(4-isoquinolin-8-ylpiperazin-1-yl)butyl]anthracene-2-carboxamide Openeye Name: N-[4-[4-(8-isoquinolyl)piperazin-1-yl]butyl]anthracene-2-carboxamide CAS Name: N-[4-[4-(8-isoquinolinyl)-1-piperazinyl]butyl]-2-anthracenecarboxamide IUPAC Name: N-[4-(4-isoquinolin-8-ylpiperazin-1-yl)butyl]anthracene-2-carboxamide Traditional Name: N-[4-[4-(8-isoquinolyl)piperazino]butyl]anthracene-2-carboxamide Formula: C32H32N4O MolecularWeight: 488.62268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C2=CC3=CC4=CC=CC=C4C=C3C=C2)C5=CC=CC6=C5C=NC=C6

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)C2=CC3=CC4=CC=CC=C4C=C3C=C2)C5=CC=CC6=C5C=NC=C6

InChI

InChI=1S/C32H32N4O/c37-32(28-11-10-27-20-25-6-1-2-7-26(25)21-29(27)22-28)34-13-3-4-15-35-16-18-36(19-17-35)31-9-5-8-24-12-14-33-23-30(24)31/h1-2,5-12,14,20-23H,3-4,13,15-19H2,(H,34,37)